Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.56 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.56 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.56 |
| ▸ | PPOX | P50336 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 2/20 | 0.40 |
| ▸ | PKM | P14618 | 2/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | RECQL | P46063 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | ESR1 | P03372 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL8600272 | 0.98 | ALDH1A1 (0.54) | ALDH1A1L3MBTL1TDP1PPOXTSHR | |
| SCHEMBL8599287 | 0.94 | L3MBTL1 (0.48) | ALDH1A1L3MBTL1TDP1PPOXTSHR | |
| SCHEMBL8600440 | 0.90 | PPOX (0.50) | ALDH1A1L3MBTL1TDP1PPOXTSHR | |
| SCHEMBL8600619 | 0.86 | SMN1; SMN2 (0.42) | ALDH1A1L3MBTL1TDP1PPOXTSHR | |
| SCHEMBL8599998 | 0.85 | LMNA (0.56) | ALDH1A1L3MBTL1TDP1PPOXTSHR | |
| SCHEMBL8598193 | 0.84 | ELANE (0.39) | ALDH1A1L3MBTL1TDP1TSHRHTT | |
| SCHEMBL8603664 | 0.83 | SMN1; SMN2 (0.40) | ALDH1A1L3MBTL1TDP1PPOXTSHR | |
| SCHEMBL8598539 | 0.82 | ELANE (0.38) | ALDH1A1L3MBTL1TDP1TSHRHTT | |
| SCHEMBL10550045 | 0.82 | LMNA (0.38) | ALDH1A1L3MBTL1TDP1PPOXTSHR | |
| SCHEMBL8602405 | 0.82 | LMNA (0.40) | ALDH1A1L3MBTL1TDP1PPOXTSHR |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0626370-B1 | Process for producing aromatic isothiocyanate derivatives | SUMITOMO CHEMICAL CO (JP) | 1998-02-11 | — | — | EP | disclosed |
| EP-0626370-A1 | Process for producing aromatic isothiocyanate derivatives | SUMITOMO CHEMICAL COMPANY LIMITED (JP) | 1994-11-30 | — | — | EP | disclosed |